# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17912091
_cell_length_b   22.43602757
_cell_length_c   46.46179256
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.92243748
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg64
_cell_volume   3305.58440767
_cell_formula_units_Z   64
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Mg  Mg1  1  0.848634  0.247164  0.307822  1
  Mg  Mg2  1  0.588292  0.767716  0.281520  1
  Mg  Mg3  1  0.656380  0.631212  0.295781  1
  Mg  Mg4  1  0.917106  0.109674  0.322959  1
  Mg  Mg5  1  0.218428  0.507278  0.294115  1
  Mg  Mg6  1  0.479056  0.985837  0.321197  1
  Mg  Mg7  1  0.780257  0.383929  0.292455  1
  Mg  Mg8  1  0.041049  0.862025  0.318985  1
  Mg  Mg9  1  0.371464  0.201275  0.363105  1
  Mg  Mg10  1  0.110405  0.723374  0.335892  1
  Mg  Mg11  1  0.179284  0.585472  0.351259  1
  Mg  Mg12  1  0.440292  0.063376  0.378475  1
  Mg  Mg13  1  0.741013  0.462166  0.349404  1
  Mg  Mg14  1  1.002035  0.939978  0.376543  1
  Mg  Mg15  1  0.302699  0.339007  0.347544  1
  Mg  Mg16  1  0.563788  0.816600  0.374663  1
  Mg  Mg17  1  0.894378  0.155381  0.418579  1
  Mg  Mg18  1  0.633100  0.677951  0.391109  1
  Mg  Mg19  1  0.702012  0.540024  0.406968  1
  Mg  Mg20  1  0.963209  0.017554  0.434233  1
  Mg  Mg21  1  0.263724  0.416735  0.405039  1
  Mg  Mg22  1  0.524917  0.894243  0.432261  1
  Mg  Mg23  1  0.825457  0.293415  0.402952  1
  Mg  Mg24  1  0.086694  0.770810  0.430386  1
  Mg  Mg25  1  0.417167  0.109782  0.474221  1
  Mg  Mg26  1  0.155826  0.632487  0.446661  1
  Mg  Mg27  1  0.224819  0.494416  0.462638  1
  Mg  Mg28  1  0.486026  0.971911  0.489971  1
  Mg  Mg29  1  0.786562  0.371046  0.460634  1
  Mg  Mg30  1  0.047754  0.848571  0.487959  1
  Mg  Mg31  1  0.348284  0.247717  0.458494  1
  Mg  Mg32  1  0.609529  0.725139  0.486087  1
  Mg  Mg33  1  0.939939  0.064218  0.529884  1
  Mg  Mg34  1  0.678645  0.586847  0.502299  1
  Mg  Mg35  1  0.747646  0.448765  0.518274  1
  Mg  Mg36  1  0.008816  0.926309  0.545649  1
  Mg  Mg37  1  0.309377  0.325408  0.516232  1
  Mg  Mg38  1  0.570578  0.802912  0.543611  1
  Mg  Mg39  1  0.871078  0.202107  0.514127  1
  Mg  Mg40  1  0.132378  0.679439  0.541736  1
  Mg  Mg41  1  0.462695  0.018679  0.585539  1
  Mg  Mg42  1  0.201507  0.541138  0.558013  1
  Mg  Mg43  1  0.270428  0.403207  0.573911  1
  Mg  Mg44  1  0.531621  0.880652  0.601222  1
  Mg  Mg45  1  0.832179  0.279799  0.571844  1
  Mg  Mg46  1  0.093415  0.757224  0.599221  1
  Mg  Mg47  1  0.393878  0.156494  0.569829  1
  Mg  Mg48  1  0.655197  0.633799  0.597352  1
  Mg  Mg49  1  0.985542  0.972918  0.641020  1
  Mg  Mg50  1  0.724391  0.495410  0.613865  1
  Mg  Mg51  1  0.793277  0.357483  0.629405  1
  Mg  Mg52  1  0.054348  0.835121  0.656631  1
  Mg  Mg53  1  0.354982  0.234201  0.627482  1
  Mg  Mg54  1  0.616111  0.711827  0.654848  1
  Mg  Mg55  1  0.916715  0.110819  0.625587  1
  Mg  Mg56  1  0.177868  0.588474  0.652857  1
  Mg  Mg57  1  0.508304  0.927173  0.696291  1
  Mg  Mg58  1  0.247360  0.449552  0.669722  1
  Mg  Mg59  1  0.315900  0.312117  0.684550  1
  Mg  Mg60  1  0.576681  0.790430  0.711735  1
  Mg  Mg61  1  0.877738  0.188725  0.682746  1
  Mg  Mg62  1  0.138506  0.667094  0.710111  1
  Mg  Mg63  1  0.439776  0.064748  0.681111  1
  Mg  Mg64  1  0.700035  0.544211  0.707617  1
